Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.58 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.57 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.57 |
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.55 |
| ▸ | BLM | P54132 | 1/20 | 0.55 |
| ▸ | CA1 | P00915 | 2/20 | 0.51 |
| ▸ | CA2 | P00918 | 2/20 | 0.51 |
| ▸ | ACHE | P22303 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | CA12 | O43570 | 1/20 | 0.47 |
| ▸ | CA7 | P43166 | 1/20 | 0.47 |
| ▸ | CA9 | Q16790 | 1/20 | 0.47 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.47 |
| ▸ | HTR2A | P28223 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL4981765 | 0.82 | HTT (0.66) | HTTADRA1AADRA2ACYP2D6MEN1 | |
| SCHEMBL3610280 | 0.81 | HTT (0.59) | HTTADRA1AADRA2ACYP2D6MEN1 | |
| Hydrochloric Acid SCHEMBL5761162 | 0.80 | ALDH1A1 (0.40) | HTTADRA1AADRA2ACYP2D6MEN1 | |
| SCHEMBL28963070 | 0.79 | HTT (0.58) | HTTADRA1AADRA2ACYP2D6MEN1 | |
| SCHEMBL2928368 | 0.79 | HTT (0.58) | HTTADRA1AADRA2ACYP2D6MEN1 | |
| SCHEMBL5759427 | 0.78 | CA1 (0.46) | HTTMEN1KMT2ACA1CA2 | |
| SCHEMBL2498221 | 0.78 | ADRA1A (0.74) | HTTADRA1AADRA2ACYP2D6MEN1 | |
| Hydrochloric Acid SCHEMBL5756769 | 0.77 | IDO1 (0.47) | HTTMEN1KMT2ACA1CA2 | |
| SCHEMBL6500258 | 0.76 | HTR2A (0.67) | HTTADRA1AALDH1A1HTR2AGAA | |
| SCHEMBL27546835 | 0.76 | HTT (0.54) | HTTADRA1AADRA2ACYP2D6MEN1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1465860-A1 | AN IMPROVED PROCESS FOR THE SYNTHESIS OF ( ) 2-AMINO-N-[2,(S,5-DIMETHOXYPHENYL)-2-HYDROXYETHYL] ACETAMIDE MONOHYDROCHLORIDE | Sanmar Speciality Chemicals Ltd (IN) | 2004-10-13 | — | — | EP | claimed |
| EP-1465860-A4 | AN IMPROVED PROCESS FOR THE SYNTHESIS OF ( ) 2-AMINO-N-[2,(S,5-DIMETHOXYPHENYL)-2-HYDROXYETHYL] ACETAMIDE MONOHYDROCHLORIDE | SANMAR SPECIALITY CHEMICALS LT (IN) | 2004-10-13 | — | — | EP | claimed |
| WO-2004018409-A1 | AN IMPROVED PROCESS FOR THE SYNTHESIS OF (±) 2-AMINO-N-[2,(S,5-DIMETHOXYPHENYL)-2-HYDROXYETHYL] ACETAMIDE MONOHYDROCHLORIDE | SANMAR SPECIALITY CHEMICALS LTD (IN) | 2004-03-04 | — | — | WO | claimed |